Ethanone, 1-(2,3-dihydro-1H-indol-5-yl)-


Chemical Name: Ethanone, 1-(2,3-dihydro-1H-indol-5-yl)-
CAS Number: 16078-34-5
Product Number: AG001VCF(AGN-PC-0JNRC3)
Synonyms:
MDL No:
Molecular Formula: C10H11NO
Molecular Weight: 161.2004

Identification/Properties


Properties
MP:
70.5-71℃
BP:
318.4°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
161.204g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
161.084g/mol
Monoisotopic Mass:
161.084g/mol
Topological Polar Surface Area:
29.1A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
190
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


PNMR/5-Acetylindoline-16078-34-5-hnmr.PDF

Other Analytical Data


POTHER/5-Acetylindoline-16078-34-5-hplc.PDF

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Chemical Structure



1-(Indolin-5-yl)ethanone is a versatile compound commonly used in chemical synthesis as a key building block in the creation of various organic molecules and pharmaceuticals. With its indoline and ketone functional groups, this compound serves as a crucial intermediate in the synthesis of complex organic compounds due to its ability to undergo diverse chemical transformations.In chemical synthesis, 1-(Indolin-5-yl)ethanone can participate in various reactions such as nucleophilic addition, condensation, and substitution reactions to introduce different functional groups or modify the molecular structure. Its indoline moiety provides aromaticity and can act as an electron-rich system in heterocyclic chemistry, allowing for the synthesis of bioactive molecules and pharmaceuticals.Furthermore, the ketone group in 1-(Indolin-5-yl)ethanone offers opportunities for further derivatization through reduction, oxidation, or functional group interconversion reactions. This flexibility makes it a valuable building block for designing and synthesizing bioactive compounds, agrochemicals, and materials with diverse properties.Overall, the application of 1-(Indolin-5-yl)ethanone in chemical synthesis plays a vital role in the construction of complex organic molecules with potential applications in the pharmaceutical, agrochemical, and materials science industries.